CHEMBRIDGE-ZINC04991056 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 42 0 0 0 0 0 0 0 0999 V2000 2.2870 -0.2150 -2.5450 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8040 -1.4120 -1.7240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6190 -1.9490 -2.3160 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0570 -3.0250 -1.7040 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0950 -3.5950 -2.2270 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6680 -4.6870 -1.6090 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0880 -5.2180 -0.4570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0690 -4.6430 0.0650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6400 -3.5540 -0.5600 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7020 -6.3910 0.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1800 -6.9410 1.3260 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1950 -8.3010 1.7990 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.2480 -7.9940 0.4200 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8010 -6.9660 -0.2430 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.4510 -8.7730 0.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3600 -10.1210 -0.1110 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0440 -10.7720 -0.1270 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9140 -12.1060 0.2790 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6760 -12.7100 0.2610 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5610 -12.0020 -0.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6820 -10.6820 -0.5620 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9140 -10.0650 -0.5550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1340 -12.8400 -0.1790 Br 0 0 0 0 0 0 0 0 0 0 0 0 -5.7150 -8.1150 -0.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7180 -7.5930 -0.1740 N 0 0 0 0 0 0 0 0 0 0 0 0 3.1910 0.1940 -2.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5040 -0.5380 -3.5640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5110 0.5500 -2.5640 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5800 -2.1770 -1.7050 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5870 -1.0900 -0.7050 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5430 -3.1840 -3.1190 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5640 -5.1300 -2.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5200 -5.0510 0.9580 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5380 -3.1110 -0.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2920 -6.6050 1.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2550 -10.7090 -0.2460 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7820 -12.6590 0.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5730 -13.7390 0.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1920 -10.1360 -0.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0070 -9.0370 -0.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 29 1 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 31 1 0 0 0 0 6 7 1 0 0 0 0 6 32 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 33 1 0 0 0 0 9 34 1 0 0 0 0 10 11 2 0 0 0 0 10 14 1 0 0 0 0 11 12 1 0 0 0 0 11 35 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 2 0 0 0 0 15 24 1 0 0 0 0 16 17 1 0 0 0 0 16 36 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 37 1 0 0 0 0 19 20 1 0 0 0 0 19 38 1 0 0 0 0 20 21 2 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 21 39 1 0 0 0 0 22 40 1 0 0 0 0 24 25 3 0 0 0 0 M END